Gweld yr adroddiad uchod. Defnyddiwch y sylwadau isod os oes angen ymgysylltu pellach arnoch.
Nid yw'r sbectrwm wedi'i nodi'n ddiogel fel 6-Chlorohexan-1-ol. Dychwelodd y chwiliad FTIR cyffredin y cofnod llyfrgell hwnnw fel yr ymgeisydd enwedig agosaf, ond mae'r holl debygrwydd a adroddir yn 0.000 ac nid oes unrhyw dystiolaeth llenyddiaeth uniongyrchol neu gysylltiedig yn cefnogi'r aseiniad penodol hwnnw'n annibynnol. Mae'r bandiau a arsylwyd yn cael eu dehongli'n fwy diogel fel deunydd organig ocsigenedig aliffatig sy'n dangos amsugnedd O-H gref, sy'n gyson iawn ar hyn o bryd â sampl o alcohol neu fath polyol yn hytrach nag alcohol clorinedig sydd wedi'i sefydlu'n gadarn.
Camau nesaf a argymhellir: Recollect the FTIR spectrum with confirmed background subtraction and full band-shape review, especially in the 3600-3000 and 1200-900 cm-1 regions, to confirm whether the O-H envelope is broad and whether the C-O bands are internally consistent with a monoalcohol or polyol. Check specifically for characteristic C-Cl absorption in the lower fingerprint region below the currently listed peaks before accepting any chlorinated alcohol assignment. If available, run GC-MS or LC-MS to determine whether the sample is a single low-molecular-weight oxygenated compound or a mixture. Acquire complementary NMR, particularly 1H and 13C NMR, to distinguish a simple aliphatic alcohol from a diol or other oxygenated material.
| Safle | Cyfateb % | Cyfansawdd | SMILES | Rhif sbectrwm | Gweithred |
|---|---|---|---|---|---|
| Yn llwytho ymgeiswyr llyfrgell... | |||||
| # | Rhif ton (cm⁻¹) | Amsugnedd | Asiwniad | Dyfyniad | Statws neilltuaeth | |
|---|---|---|---|---|---|---|
| 1 | · | 2969 | 1.00 | - | - | - |
| 2 | · | 2930 | 0.96 | - | - | - |
| 3 | · | 2867 | 0.89 | - | - | - |
| 4 | · | 3362 | 0.83 | - | - | - |
| 5 | · | 3301 | 0.76 | - | - | - |
| 6 | · | 3323 | 0.74 | - | - | - |
| 7 | · | 3194 | 0.71 | - | - | - |
| 8 | · | 1058 | 0.44 | - | - | - |
| 9 | · | 919 | 0.43 | - | - | - |
| 10 | · | 969 | 0.43 | - | - | - |
| 11 | · | 1135 | 0.36 | - | - | - |
| 12 | · | 1374 | 0.32 | - | - | - |
| 13 | · | 1461 | 0.27 | - | - | - |
| 14 | · | 1604 | 0.27 | - | - | - |
| 15 | · | 1338 | 0.24 | - | - | - |
| 16 | · | 1189 | 0.14 | - | - | - |
Defnyddiwch yr ardal hon i barhau â'r dehongliad, gofyn cwestiynau, neu ychwanegu tystiolaeth ddilysu ychwanegol.
FTIR.fun
The above shows the FTIR analysis results of a jpeg file uploaded by a user from USA. The original image is displayed below.
CSV FILE:tem.csv
en&2